N-[(2S)-1-(azepan-1-yl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-(7-methoxy-2-oxidanylidene-chromen-4-yl)ethanamide

Systemtic Name: N-[(2S)-1-(azepan-1-yl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-(7-methoxy-2-oxidanylidene-chromen-4-yl)ethanamide Openeye Name: N-[(1S)-2-(azepan-1-yl)-1-(hydroxymethyl)-2-oxo-ethyl]-2-(7-methoxy-2-oxo-chromen-4-yl)acetamide CAS Name: N-[(2S)-1-(1-azepanyl)-3-hydroxy-1-oxopropan-2-yl]-2-(7-methoxy-2-oxo-1-benzopyran-4-yl)acetamide IUPAC Name: N-[(2S)-1-(azepan-1-yl)-3-hydroxy-1-oxopropan-2-yl]-2-(7-methoxy-2-oxochromen-4-yl)acetamide Traditional Name: N-[(1S)-2-(azepan-1-yl)-2-keto-1-methylol-ethyl]-2-(2-keto-7-methoxy-chromen-4-yl)acetamide Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NC(CO)C(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N[C@@H](CO)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H26N2O6/c1-28-15-6-7-16-14(11-20(26)29-18(16)12-15)10-19(25)22-17(13-24)21(27)23-8-4-2-3-5-9-23/h6-7,11-12,17,24H,2-5,8-10,13H2,1H3,(H,22,25)/t17-/m0/s1